Random Force in Molecular Dynamics with Electronic Friction

Inelastic Scattering of H Atoms from Surfaces

(2021) Oliver Bünermann et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Energy Dissipation Effects on the Adsorption Dynamics of N2 on W(100)

(2019) Alejandro Peña-Torres et al.   Journal of Physical Chemistry C

Inelastic H and D atom scattering from Au(111) as benchmark for theory

(2019) Hongyan Jiang et al.   JOURNAL OF CHEMICAL PHYSICS

Orbital-Dependent Electronic Friction Significantly Affects the Description of Reactive Scattering of N2 from Ru(0001)

(2019) Paul Spiering et al.   Journal of Physical Chemistry Letters

Symmetry-Adapted High Dimensional Neural Network Representation of Electronic Friction Tensor of Adsorbates on Metals

(2019) Yaolong Zhang et al.   Journal of Physical Chemistry C

Hydrogen collisions with transition metal surfaces: Universal electronically nonadiabatic adsorption

(2018) Yvonne Dorenkamp et al.   JOURNAL OF CHEMICAL PHYSICS

Perspective: How to understand electronic friction

(2018) Wenjie Dou et al.   JOURNAL OF CHEMICAL PHYSICS

Born-Oppenheimer Dynamics, Electronic Friction, and the Inclusion of Electron-Electron Interactions

(2017) Wenjie Dou et al.   PHYSICAL REVIEW LETTERS

Non-adiabatic effects in elementary reaction processes at metal surfaces

(2017) M. Alducin et al.   PROGRESS IN SURFACE SCIENCE

Electron–Hole Pair Effects in Polyatomic Dissociative Chemisorption: Water on Ni(111)

(2016) Bin Jiang et al.   Journal of Physical Chemistry Letters

Hydrogen abstraction from metal surfaces: when electron–hole pair excitations strongly affect hot-atom recombination

(2016) Oihana Galparsoro et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Role of Tensorial Electronic Friction in Energy Transfer at Metal Surfaces

(2016) Mikhail Askerka et al.   PHYSICAL REVIEW LETTERS

An accurate full-dimensional potential energy surface for H–Au(111): Importance of nonadiabatic electronic excitation in energy transfer and adsorption

(2015) Svenja M. Janke et al.   JOURNAL OF CHEMICAL PHYSICS

Ab initiomolecular dynamics with simultaneous electron and phonon excitations: Application to the relaxation of hot atoms and molecules on metal surfaces

(2015) D. Novko et al.   PHYSICAL REVIEW B

Electronic Friction-Based Vibrational Lifetimes of Molecular Adsorbates: Beyond the Independent-Atom Approximation

(2015) Simon P. Rittmeyer et al.   PHYSICAL REVIEW LETTERS

Electron-hole pair excitation determines the mechanism of hydrogen atom adsorption

(2015) O. Bunermann et al.   SCIENCE

Dynamics of H2 Eley-Rideal abstraction from W(110): Sensitivity to the representation of the molecule-surface potential

(2014) R. Pétuya et al.   JOURNAL OF CHEMICAL PHYSICS

Vibrational lifetimes of hydrogen on lead films: An ab initio molecular dynamics with electronic friction (AIMDEF) study

(2014) Peter Saalfrank et al.   JOURNAL OF CHEMICAL PHYSICS

Electronic Friction Dominates Hydrogen Hot-Atom Relaxation on Pd(100)

(2014) M. Blanco-Rey et al.   PHYSICAL REVIEW LETTERS

Toward Detection of Electron-Hole Pair Excitation in H-atom Collisions with Au(111): Adiabatic Molecular Dynamics with a Semi-Empirical Full-Dimensional Potential Energy Surface

(2013) Svenja M. Janke et al.   ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS

Role of Electron-Hole Pair Excitations in the Dissociative Adsorption of Diatomic Molecules on Metal Surfaces

(2008) J. I. Juaristi et al.   PHYSICAL REVIEW LETTERS